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N-(2-{[2-(tert-butylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-fluorobenzamide
SpectraBase Compound ID KRzxOPPLWlH
InChI InChI=1S/C20H20FN3O2S2/c1-20(2,3)24-17(25)11-27-19-23-15-9-8-12(10-16(15)28-19)22-18(26)13-6-4-5-7-14(13)21/h4-10H,11H2,1-3H3,(H,22,26)(H,24,25)
InChIKey OHJWFUSJKXYMBX-UHFFFAOYSA-N
Mol Weight 417.52 g/mol
Molecular Formula C20H20FN3O2S2
Exact Mass 417.098097 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7NTS0d7GAAa
Name N-(2-{[2-(tert-butylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-fluorobenzamide
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C20H20FN3O2S2/c1-20(2,3)24-17(25)11-27-19-23-15-9-8-12(10-16(15)28-19)22-18(26)13-6-4-5-7-14(13)21/h4-10H,11H2,1-3H3,(H,22,26)(H,24,25)
InChIKey OHJWFUSJKXYMBX-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7529_506
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: ZI/7101626; Labnumber: LP-0603112
Temperature 303 °C